General Information of the Compound
| Compound ID |
CP0446231
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| Compound Name |
2-{1-[2-(pyrrolidin-1-yl)ethyl]- 1H-imidazol-4-yl}-4-(2H- tetrazol-5-yl)pyridine
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| Structure |
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| Formula |
C15H18N8
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| Molecular Weight |
310.365
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| Canonical SMILES |
C(Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1)N1CCCC1
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| InChI |
InChI=1S/C15H18N8/c1-2-6-22(5-1)7-8-23-10-14(17-11-23)13-9-12(3-4-16-13)15-18-20-21-19-15/h3-4,9-11H,1-2,5-8H2,(H,18,19,20,21)
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| InChIKey |
GGAYQPAKFUJHFR-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT03776, Lysine-specific demethylase 2B
Protein ID: PT02979, Lysine-specific demethylase 4C
Protein ID: PT02613, Lysine-specific demethylase 5A
Protein ID: PT03382, Lysine-specific demethylase 5B